2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone

C10H12F3NO2 — CID 102652482

IUPAC2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone
SMILESO=C(C1=CCCO1)C1(C(F)(F)F)CCNC1
InChIInChI=1S/C10H12F3NO2/c11-10(12,13)9(3-4-14-6-9)8(15)7-2-1-5-16-7/h2,14H,1,3-6H2
InChIKeyPZXXEBPHWWDZER-UHFFFAOYSA-N
MW235.20 g/mol
LogP1.40
Rot. Bonds2

About 2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone

2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone (PubChem CID 102652482) has the molecular formula C10H12F3NO2 and a molecular weight of 235.20 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone
PubChem CID102652482
Molecular FormulaC10H12F3NO2
Molecular Weight235.20 g/mol
Exact Mass235.08
IUPAC Name2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone
SMILESO=C(C1=CCCO1)C1(C(F)(F)F)CCNC1
InChIInChI=1S/C10H12F3NO2/c11-10(12,13)9(3-4-14-6-9)8(15)7-2-1-5-16-7/h2,14H,1,3-6H2
InChIKeyPZXXEBPHWWDZER-UHFFFAOYSA-N
XLogP1.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.20
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone?
The IUPAC name of 2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone (CID 102652482) is 2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone?
The canonical SMILES for 2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone is O=C(C1=CCCO1)C1(C(F)(F)F)CCNC1.
What is the InChIKey of 2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone?
The InChIKey is PZXXEBPHWWDZER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3NO2/c11-10(12,13)9(3-4-14-6-9)8(15)7-2-1-5-16-7/h2,14H,1,3-6H2.
What are the key properties of 2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone?
2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone has a molecular weight of 235.20 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl-[3-(trifluoromethyl)pyrrolidin-3-yl]methanone is sourced from PubChem (CID 102652482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).